methyl 5-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 2-(allylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 2-(allylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C11H14N2O2S2 MolecularWeight: 270.37106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NCC=C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NCC=C)C(=O)OC

InChI

InChI=1S/C11H14N2O2S2/c1-4-5-12-11(16)13-9-8(10(14)15-3)6-7(2)17-9/h4,6H,1,5H2,2-3H3,(H2,12,13,16)